For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,5R)-1-[2-[[(3-methylanilino)-oxomethyl]amino]-1-oxoethyl]-5-phenyl-2-pyrrolidinecarboxylic acid tert-butyl ester
SpectraBase Compound ID 37WXUDSENqG
InChI InChI=1S/C25H31N3O4/c1-17-9-8-12-19(15-17)27-24(31)26-16-22(29)28-20(18-10-6-5-7-11-18)13-14-21(28)23(30)32-25(2,3)4/h5-12,15,20-21H,13-14,16H2,1-4H3,(H2,26,27,31)/t20-,21+/m1/s1
InChIKey TYDQXMRDEQXQBA-RTWAWAEBSA-N
Mol Weight 437.54 g/mol
Molecular Formula C25H31N3O4
Exact Mass 437.231456 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5knpZ2uoRLk
Name (2S,5R)-1-[2-[[(3-methylanilino)-oxomethyl]amino]-1-oxoethyl]-5-phenyl-2-pyrrolidinecarboxylic acid tert-butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31N3O4
InChI InChI=1S/C25H31N3O4/c1-17-9-8-12-19(15-17)27-24(31)26-16-22(29)28-20(18-10-6-5-7-11-18)13-14-21(28)23(30)32-25(2,3)4/h5-12,15,20-21H,13-14,16H2,1-4H3,(H2,26,27,31)/t20-,21+/m1/s1
InChIKey TYDQXMRDEQXQBA-RTWAWAEBSA-N
Molecular Weight 437.540 g/mol
SMILES N(C(Nc1cc(C)ccc1)=O)CC(N1[C@](C(OC(C)(C)C)=O)(CC[C@@]1(c1ccccc1)[H])[H])=O
SPLASH splash10-0a4j-1900000000-90b9cfa922bb5eb232b2
Source of Spectrum QC-5-238-0
Synonyms tert-Butyl (2S,5R)-1-[2-[(3-methylphenyl)carbamoylamino]acetyl]-5-phenylpyrrolidine-2-carboxylate tert-Butyl (2S,5R)-1-[2-(m-tolylcarbamoylamino)acetyl]-5-phenyl-pyrrolidine-2-carboxylate tert-Butyl (2S,5R)-1-[2-[(3-methylphenyl)carbamoylamino]ethanoyl]-5-phenyl-pyrrolidine-2-carboxylate (2S,5R)-tert-Butyl 1-{2-(3-(3-methylphenyl)ureido]-1-oxoethyl}-5-phenylpyrrolidine-2-carboxylate (RP (+)-66803)
Wiley ID 883492